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MassBank Record: WA000507

Fenspiride; LC-ESI-Q; MS; POS; 60 V

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: WA000507
RECORD_TITLE: Fenspiride; LC-ESI-Q; MS; POS; 60 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Fenspiride
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H20N2O2
CH$EXACT_MASS: 260.15248
CH$SMILES: O=C(N3)OC(C3)(C1)CCN(CCc(c2)cccc2)C1
CH$IUPAC: InChI=1S/C15H20N2O2/c18-14-16-12-15(19-14)7-10-17(11-8-15)9-6-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,16,18)
CH$LINK: CAS 5053-06-5
CH$LINK: INCHIKEY FVNFBBAOMBJTST-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4023048

AC$INSTRUMENT: ZQ, Waters
AC$INSTRUMENT_TYPE: LC-ESI-Q
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$CHROMATOGRAPHY: RETENTION_TIME 10.380 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 60 V

MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-0a4i-0900000000-c989a814d626ddc304f4
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  103 20 20
  105 999 999
  106 82 82
  134 20 20
  146 20 20
  169 51 51
  200 12 12
  261 71 71
  262 12 12
//

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